| SpectraBase Spectrum ID |
1ZFK6SQt1rB |
| Name |
Cedren-3-one <2-epi-alpha-> |
| CAS Registry Number |
288249-25-2 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
218.167065327 u |
| Formula |
C15H22O |
| InChI |
InChI=1S/C15H22O/c1-9-5-6-15-8-11(9)14(3,4)13(15)7-12(16)10(15)2/h5,10-11,13H,6-8H2,1-4H3/t10-,11-,13-,15-/m0/s1 |
| InChIKey |
QGZLQHVSALKXDZ-UHXUCMFUSA-N |
| Molecular Weight |
218.340 g/mol |
| Number of Peaks |
50 |
| RI1 |
1630 |
| SMILES |
C1([C@@]([C@]23[C@@](C1)(C([C@@](C3)(C(=CC2)C)[H])(C)C)[H])(C)[H])=O |
| SPLASH |
splash10-05tf-9610000000-73d7d2c39676ca461d1c |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
1H-3a,7-Methanoazulen-2(3H)-one, 4,7,8,8a-tetrahydro-3,6,8,8-tetramethyl- |
| Wiley ID |
LM_FFNSC3_2789 |
